Configuration Set

ANI-2x-wB97MD3BJ-def2TZVPP_num_atoms_14__CS_365ti9bl8aan_0



Name ANI-2x-wB97MD3BJ-def2TZVPP_num_atoms_14
Extended ID ANI-2x-wB97MD3BJ-def2TZVPP_num_atoms_14__CS_365ti9bl8aan_0
Description Configurations with 14 atoms from ANI-2x-wB97MD3BJ-def2TZVPP dataset
Elements C (28.93%)
Cl (0.69%)
F (0.8%)
H (47.69%)
N (11.91%)
O (6.42%)
S (3.57%)
Number of Configurations 934,143
Number of Atoms 13,078,002
Configurations